Ho3Tc2Pb3
Alexandria ALEXAlex-ID: agm009337121 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_13_spg12
Tc HoPb
2024-06-01 22:29:20.785879
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009337121).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
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# CIF generated by HEAS from Alexandria entry agm009337121
data_agm009337121
_cell_length_a 9.16984
_cell_length_b 9.16984
_cell_length_c 5.35651
_cell_angle_alpha 80.38318
_cell_angle_beta 80.38318
_cell_angle_gamma 27.66982
_cell_volume 206.03924
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Ho1 Ho 0.16611 0.16611 0.93236 1.00000
Ho2 Ho 0.83389 0.83389 0.06764 1.00000
Ho3 Ho 0.00000 0.00000 0.50000 1.00000
Tc1 Tc 0.22699 0.22699 0.42609 1.00000
Tc2 Tc 0.77301 0.77301 0.57391 1.00000
Pb1 Pb 0.62522 0.62522 0.43010 1.00000
Pb2 Pb 0.50000 0.50000 0.00000 1.00000
Pb3 Pb 0.37478 0.37478 0.56990 1.00000
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